- InChI
- InChI=1S/C10H18O/c1-8(2)9-4-6-10(3,11)7-5-9/h9,11H,1,4-7H2,2-3H3/t9-,10-
- InChI Key
- RUJPNZNXGCHGID-MGCOHNPYSA-N
- Formula
- C10H18O
- SMILES
- C=C(C)C1CCC(C)(O)CC1
- Molecular Weight1
- 154.25
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -12.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -237.10 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.91 | kJ/mol | Joback Calculated Property |
| log10WS | -2.89 | Crippen Calculated Property | |
| logPoct/wat | 2.504 | Crippen Calculated Property | |
| McVol | 142.470 | ml/mol | McGowan Calculated Property |
| Pc | 3012.33 | kPa | Joback Calculated Property |
| I | [1570.00; 1570.00] |
|
|
| I | 1570.00 | NIST | |
| I | 1570.00 | NIST | |
| Tboil | 532.06 | K | Joback Calculated Property |
| Tc | 732.54 | K | Joback Calculated Property |
| Tfus | 274.60 | K | Joback Calculated Property |
| Vc | 0.526 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [349.49; 434.60] | J/mol×K | [532.06; 732.54] |
|
| Cp,gas | 349.49 | J/mol×K | 532.06 | Joback Calculated Property |
| Cp,gas | 365.75 | J/mol×K | 565.47 | Joback Calculated Property |
| Cp,gas | 381.06 | J/mol×K | 598.89 | Joback Calculated Property |
| Cp,gas | 395.50 | J/mol×K | 632.30 | Joback Calculated Property |
| Cp,gas | 409.18 | J/mol×K | 665.71 | Joback Calculated Property |
| Cp,gas | 422.18 | J/mol×K | 699.12 | Joback Calculated Property |
| Cp,gas | 434.60 | J/mol×K | 732.54 | Joback Calculated Property |
Similar Compounds
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Sources
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